V012-5195 Screening compound: ethyl 2-[4-({5-[(3,5-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoacetate

V012-5195 Screening compound: ethyl 2-[4-({5-[(3,5-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoacetate
V012-5195 Screening compound: ethyl 2-[4-({5-[(3,5-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-5195
ethyl 2-[4-({5-[(3,5-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoacetate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V012-5195

Molecular Formula

C23H28N2O6 (C23 H28 N2 O6)

Compound Name

ethyl 2-[4-({5-[(3,5-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoacetate

IUPAC name

ethyl 2-[4-({5-[(35-dimethylphenyl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-2-oxoacetate

SMILES

CCOC(C(N1CCN(CC(OC=C2OCc3cc(C)cc(C)c3)=CC2=O)CC1)=O)=O

InChI

InChI=1S/C23H28N2O6/c1-4-29-23(28)22(27)25-7-5-24(6-8-25)13-19-12-20(26)21(15-30-19)31-14-18-10-16(2)9-17(3)11-18/h9-12,15H,4-8,13-14H2,1-3H3

InChI Key

PZFJXWHDKIEJQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19945773

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

428.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.668

Distribution Coefficient, logD

2.668

Water Solubility, LogSw

-2.70

Polar Surface Area

71.364

Acid Dissociation Constant (pKa)

28.36

Base Dissociation Constant (pKb)

3.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

V012-5195 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V012-5195 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-5195?
Check Price and Availability of V012-5195, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V012-5195 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-5195
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-5195
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V012-5195 available by request